Analysis of strain/apical distances responses in LCO 214-like structures

This note book extrat the data from finished calculations, plot and output CSV table for further analysis.

export_group = Group.objects.get_or_create(label='cu-apical-response/exports')[0]

Plot results - under a strain along the c direction

The a and b directions are left to be fully optimised

LCO 214

Y123

view(Y123_struct.get_ase())

Hg1223

Extracting results with both c and ab strained

Y123

Hg1223

LCO 214